E632-0283 Screening compound: N-(3-chloro-4-fluorophenyl)-4-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]piperidine-1-carboxamide

E632-0283 Screening compound: N-(3-chloro-4-fluorophenyl)-4-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]piperidine-1-carboxamide
E632-0283 Screening compound: N-(3-chloro-4-fluorophenyl)-4-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]piperidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E632-0283
N-(3-chloro-4-fluorophenyl)-4-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]piperidine-1-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

E632-0283

Molecular Formula

C22H25ClFN3O (C22 H25 ClFN3 O)

Compound Name

N-(3-chloro-4-fluorophenyl)-4-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]piperidine-1-carboxamide

IUPAC name

N-(3-chloro-4-fluorophenyl)-4-[(1234-tetrahydroisoquinolin-2-yl)methyl]piperidine-1-carboxamide

SMILES

O=C(Nc(cc1)cc(Cl)c1F)N1CCC(CN(CC2)Cc3c2cccc3)CC1

InChI

InChI=1S/C22H25ClFN3O/c23-20-13-19(5-6-21(20)24)25-22(28)27-11-7-16(8-12-27)14-26-10-9-17-3-1-2-4-18(17)15-26/h1-6,13,16H,7-12,14-15H2,(H,25,28)

InChI Key

GRCBQZAGISYWQH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14905680

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.91

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.781

Distribution Coefficient, logD

3.170

Water Solubility, LogSw

-5.03

Polar Surface Area

29.102

Acid Dissociation Constant (pKa)

10.35

Base Dissociation Constant (pKb)

9.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

E632-0283 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Inflammatory Library (24602 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with E632-0283 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E632-0283?
Check Price and Availability of E632-0283, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E632-0283 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E632-0283
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E632-0283
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of E632-0283 available by request